CID 3075571

186424-09-9

Structural Information

Molecular Formula
C11H13ClN2S
SMILES
CCN1C(CNC1=S)C2=CC=CC=C2Cl
InChI
InChI=1S/C11H13ClN2S/c1-2-14-10(7-13-11(14)15)8-5-3-4-6-9(8)12/h3-6,10H,2,7H2,1H3,(H,13,15)
InChIKey
INNNPHXHMAWGKJ-UHFFFAOYSA-N
Compound name
5-(2-chlorophenyl)-1-ethylimidazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.0488 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.056076 152.2
[M+Na]+ 263.038018 161.9
[M-H]- 239.041524 155.3
[M+NH4]+ 258.082623 170.2
[M+K]+ 279.011958 155.3
[M+H-H2O]+ 223.046060 145.9
[M+HCOO]- 285.047001 161.9
[M+CH3COO]- 299.062651 163.9
[M+Na-2H]- 261.023466 150.7
[M]+ 240.04825142 152.0
[M]- 240.04934858 152.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.